data_3bmp_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 3bmp _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.0 ptt85 . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 120.847 0.356 . . . . 89.489999999999995 111.815 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 29.8 tp 176.6 115.96 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.345 -0.389 . . . . 82.480000000000004 110.372 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -156.67 -174.21 4.83 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.19 0.811 . . . . 78.849999999999994 113.19 -179.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 89.6 p -64.12 -163.49 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 114.19 -1.368 . . . . 71.409999999999997 111.586 -176.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.5 p -39.98 157.47 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 114.952 -1.022 . . . . 60.439999999999998 113.283 -175.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 53.2 t -56.85 129.29 40.78 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 112.796 -2.002 . . . . 48.299999999999997 108.272 178.075 -178.963 52.573 78.522 106.102 1.958 106.934 69.261 178.06 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . 0.458 ' NZ ' ' CB ' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -160.9 167.87 25.76 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.98 0.419 . . . . 46.5 111.344 179.487 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -88.67 135.67 33.39 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.735 -0.666 . . . . 39.700000000000003 111.248 179.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -118.21 148.74 44.38 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 115.375 -0.83 . . . . 47.350000000000001 110.588 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -70.63 146.98 56.28 Favored 'Trans proline' 0 CA--C 1.518 -0.316 0 C-N-CA 120.683 0.922 . . . . 40.859999999999999 111.583 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 44.8 tp -165.4 109.21 0.85 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.795 -0.638 . . . . 36.909999999999997 111.121 179.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -95.65 137.42 34.74 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 104.879 -2.267 . . . . 34.619999999999997 104.879 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.1 t -117.37 117.95 56.95 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 C-N-CA 119.401 -0.92 . . . . 34.030000000000001 111.992 179.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -93.73 115.91 28.36 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 107.615 -1.254 . . . . 35.740000000000002 107.615 179.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' PHE . . . . . 0.435 ' O ' ' N ' ' A' ' 28' ' ' TRP . 22.9 m-85 -57.42 -20.13 28.17 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 115.486 1.662 . . . . 32.240000000000002 115.486 -178.719 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 66.6 m -79.09 -31.8 44.45 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.824 -0.171 . . . . 39.460000000000001 110.822 179.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -71.2 -33.52 70.01 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 120.935 -0.306 . . . . 45.719999999999999 111.159 179.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 14.1 m -97.38 10.02 6.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.505 -0.478 . . . . 40.0 110.802 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 62.09 45.74 95.46 Favored Glycine 0 N--CA 1.451 -0.304 0 N-CA-C 116.801 1.48 . . . . 37.259999999999998 116.801 178.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TRP . . . . . 0.435 ' N ' ' O ' ' A' ' 23' ' ' PHE . 14.7 m0 -116.58 -13.63 10.88 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 112.659 0.614 . . . . 36.439999999999998 112.659 179.4 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -61.24 -11.66 10.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.978 0.418 . . . . 39.740000000000002 109.876 -179.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -69.25 -40.36 77.91 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 119.588 -0.845 . . . . 40.950000000000003 109.75 179.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 19.0 p-90 -105.42 -21.89 13.13 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.792 1.034 . . . . 32.829999999999998 113.792 -179.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 58.9 mt -95.4 111.72 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.443 0 C-N-CA 119.7 -0.8 . . . . 24.18 110.441 179.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.6 t -69.88 -49.07 59.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 CA-C-N 115.461 -0.791 . . . . 22.539999999999999 110.204 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -154.25 150.38 22.22 Favored Pre-proline 0 C--O 1.235 0.336 0 CA-C-O 120.928 0.395 . . . . 25.199999999999999 110.653 -179.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -73.96 -175.92 16.23 Favored 'Cis proline' 0 N--CA 1.461 -0.395 0 N-CA-C 110.048 -0.789 . . . . 24.440000000000001 110.048 0.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -81.34 -24.72 4.29 Favored 'Trans proline' 0 N--CA 1.464 -0.244 0 N-CA-C 108.623 -1.337 . . . . 25.170000000000002 108.623 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -171.13 -167.92 32.11 Favored Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 108.265 -1.934 . . . . 25.59 108.265 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 9.7 p90 -170.18 158.26 6.77 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 114.637 1.347 . . . . 24.609999999999999 114.637 179.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -82.9 95.98 8.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.017 -0.992 . . . . 33.859999999999999 109.336 179.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -88.9 -35.48 16.48 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 114.997 1.48 . . . . 26.829999999999998 114.997 -178.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 67.24 177.84 0.24 Allowed 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.099 -1.445 . . . . 26.690000000000001 107.099 -176.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 19.2 p90 -164.62 166.24 20.33 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 108.705 -0.85 . . . . 38.630000000000003 108.705 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 69.2 m -113.14 145.35 41.1 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.541 0.686 . . . . 33.420000000000002 112.593 -178.95 -58.309 -73.426 -83.156 103.751 2.026 104.727 -76.126 -59.825 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -168.74 153.84 6.19 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.588 -0.893 . . . . 38.939999999999998 108.588 179.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 129.19 136.06 4.05 Favored Glycine 0 N--CA 1.449 -0.454 0 N-CA-C 109.429 -1.468 . . . . 41.909999999999997 109.429 -178.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -59.92 147.56 38.23 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.787 1.032 . . . . 50.75 113.787 -179.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 91.1 m -103.14 90.29 2.4 Favored Pre-proline 0 C--O 1.236 0.39 0 N-CA-C 105.994 -1.854 . . . . 51.060000000000002 105.994 177.621 -70.179 -88.072 -93.545 103.227 2.031 102.411 -87.23 -64.817 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -56.28 155.29 25.34 Favored 'Trans proline' 0 C--N 1.344 0.336 1 C-N-CA 125.614 4.209 . . . . 60.130000000000003 116.466 -179.425 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -71.94 -43.59 10.87 Favored Pre-proline 0 C--O 1.234 0.261 0 CA-C-N 115.588 -0.733 . . . . 70.5 112.62 179.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -62.54 6.67 0.18 Allowed 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 117.802 -0.999 . . . . 73.810000000000002 113.02 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 68.8 mt 39.68 88.17 0.01 OUTLIER 'General case' 0 C--O 1.239 0.504 0 N-CA-C 115.828 1.788 . . . . 75.519999999999996 115.828 178.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -47.93 133.31 14.6 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 114.406 -1.27 . . . . 75.349999999999994 112.358 169.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -65.12 -66.13 0.58 Allowed 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.511 -0.768 . . . . 78.659999999999997 110.599 -178.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' HIS . . . . . 0.408 ' ND1' ' N ' ' A' ' 55' ' ' LEU . 32.0 p80 -38.61 -42.53 0.79 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.521 -0.763 . . . . 72.549999999999997 110.496 179.913 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . 0.408 ' N ' ' ND1' ' A' ' 54' ' ' HIS . 31.8 tp -74.87 134.16 41.71 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.363 -0.977 . . . . 65.739999999999995 108.363 179.561 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -99.72 140.16 34.33 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 113.723 1.008 . . . . 55.719999999999999 113.723 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.5 m -135.56 141.3 45.16 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.316 -0.856 . . . . 45.579999999999998 109.974 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.0 p -74.07 167.52 21.38 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 104.631 -2.359 . . . . 33.780000000000001 104.631 177.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -57.86 -41.37 82.29 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 109.121 -0.696 . . . . 25.59 109.121 179.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 45.9 t60 -59.79 -50.0 75.54 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.742 -0.663 . . . . 23.0 109.867 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -51.23 -43.1 61.4 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.099 0.476 . . . . 20.640000000000001 110.396 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 74.9 mt -63.64 -48.5 86.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.215 0.531 . . . . 22.370000000000001 110.532 -179.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 75.0 t -57.79 -46.22 87.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.812 -0.631 . . . . 23.510000000000002 109.858 179.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -68.13 -36.19 79.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.153 0.501 . . . . 30.77 112.301 -178.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.7 m -60.78 -46.89 88.73 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.193 -1.04 . . . . 32.75 108.193 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 34.0 tp -62.26 -50.03 73.36 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.625 -0.716 . . . . 33.939999999999998 111.4 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 51.1 t -53.54 -48.37 58.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 108.929 -0.767 . . . . 35.189999999999998 108.929 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -52.08 -37.59 54.42 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 114.97 -1.014 . . . . 39.909999999999997 113.134 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 79.8 p -75.09 -8.92 57.9 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.834 0.679 . . . . 45.210000000000001 112.834 -179.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 93.4 t -119.29 -2.17 9.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.604 -0.888 . . . . 47.18 108.604 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -167.77 118.53 0.83 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.238 -1.393 . . . . 51.859999999999999 107.238 179.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 71.0 m -89.87 -3.32 58.15 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 117.151 2.278 . . . . 47.119999999999997 117.151 -177.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 36.0 mmtm -71.35 -12.43 61.42 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 107.903 -1.147 . . . . 49.039999999999999 107.903 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 49.7 mm -105.7 127.39 28.56 Favored Pre-proline 0 C--O 1.238 0.493 0 N-CA-C 107.291 -1.374 . . . . 37.460000000000001 107.291 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -60.79 153.25 64.06 Favored 'Trans proline' 0 C--N 1.345 0.368 1 C-N-CA 126.529 4.819 . . . . 33.32 114.345 -179.591 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 65.4 mttt -76.42 171.7 14.15 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 106.781 -1.563 . . . . 38.299999999999997 106.781 177.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.34 138.22 47.16 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 105.912 -1.885 . . . . 33.039999999999999 105.912 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.4 t -81.81 154.83 25.72 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 114.378 1.251 . . . . 30.789999999999999 114.378 -178.613 -158.461 0.0 0.0 0.0 0.0 0.0 0.0 -158.461 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 42.1 t -95.71 93.04 6.88 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.534 -0.757 . . . . 28.449999999999999 110.267 179.992 178.06 69.261 78.522 106.934 1.958 106.102 52.573 -178.963 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 13.1 m -115.91 170.85 5.22 Favored Pre-proline 0 N--CA 1.445 -0.72 0 CA-C-N 115.737 -0.665 . . . . 24.850000000000001 111.193 -179.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -72.35 135.17 24.08 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 121.537 1.491 . . . . 24.48 109.3 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 67.1 p -115.94 -13.91 11.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.963 0.411 . . . . 22.98 111.773 -179.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -138.76 117.78 12.53 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.177 -1.046 . . . . 20.559999999999999 108.177 179.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.5 mp -122.22 173.28 7.7 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.627 0.727 . . . . 18.84 112.874 -179.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 91.1 p -147.95 165.78 29.67 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 107.574 -1.269 . . . . 18.800000000000001 107.574 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -103.04 169.4 8.59 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 114.94 1.459 . . . . 16.890000000000001 114.94 -177.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 22.0 pt -144.37 154.71 15.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 106.621 -1.622 . . . . 17.690000000000001 106.621 176.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 38.4 m -89.14 148.2 23.79 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 121.323 0.582 . . . . 26.109999999999999 109.955 178.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 29.3 mtm -144.28 132.35 21.64 Favored 'General case' 0 CA--C 1.497 -1.087 0 N-CA-C 108.318 -0.993 . . . . 19.760000000000002 108.318 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 54.4 tp -100.29 120.42 39.9 Favored 'General case' 0 N--CA 1.439 -1.009 0 N-CA-C 101.628 -3.471 . . . . 19.300000000000001 101.628 178.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -141.56 -175.75 4.48 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 119.785 -0.766 . . . . 20.620000000000001 110.386 -179.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 11.5 mt -124.2 115.65 21.43 Favored 'General case' 0 C--N 1.332 -0.155 0 O-C-N 123.909 0.756 . . . . 30.850000000000001 109.015 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . 0.48 ' OD1' ' N ' ' A' ' 95' ' ' ASN . 16.8 p30 -66.46 -175.53 0.37 Allowed 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 119.131 -1.028 . . . . 38.799999999999997 110.202 -179.903 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . 0.454 ' CD ' ' N ' ' A' ' 94' ' ' GLU . 1.2 pm0 -59.29 -15.28 14.91 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 114.791 1.404 . . . . 50.579999999999998 114.791 -179.201 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASN . . . . . 0.48 ' N ' ' OD1' ' A' ' 93' ' ' ASP . 76.9 m-20 -104.26 12.23 33.93 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 113.106 0.78 . . . . 43.07 113.106 -179.909 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 67.27 27.86 8.19 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.158 0.799 . . . . 43.479999999999997 113.158 179.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -90.38 141.99 28.18 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 106.162 -1.792 . . . . 37.049999999999997 106.162 176.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 45.8 t -85.99 117.66 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 N-CA-C 108.478 -0.934 . . . . 27.789999999999999 108.478 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 4.8 t -116.77 139.32 44.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.848 -0.615 . . . . 25.280000000000001 112.105 -178.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 62.2 tp -114.22 101.69 9.43 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 102.83 -3.026 . . . . 21.890000000000001 102.83 176.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -117.98 148.76 41.9 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.908 0.385 . . . . 35.369999999999997 111.847 -178.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -99.63 101.6 12.84 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 106.414 -1.699 . . . . 37.899999999999999 106.414 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -82.52 122.04 27.55 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 114.442 1.275 . . . . 21.34 114.442 -178.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.2 mm100 -82.12 159.88 23.26 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 113.074 0.768 . . . . 33.030000000000001 113.074 -179.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 57.36 38.47 28.43 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.482 0.919 . . . . 25.149999999999999 113.482 177.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 80.0 mmm -97.82 -35.92 10.36 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.957 0.725 . . . . 20.210000000000001 112.957 -179.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 53.8 t -111.75 131.36 63.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 114.52 1.304 . . . . 18.710000000000001 114.52 -178.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 75.9 t -80.68 110.0 15.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.023 -0.535 . . . . 24.870000000000001 111.675 178.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -89.52 -47.6 7.87 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.011 -0.737 . . . . 33.43 109.011 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -133.28 153.65 20.87 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.237 -0.982 . . . . 26.870000000000001 114.717 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 84.2 m -116.78 157.25 25.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.556 0.693 . . . . 29.129999999999999 112.332 179.479 -59.825 -76.126 -83.156 104.727 2.026 103.751 -73.426 -58.309 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -162.38 177.0 38.7 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 119.4 -1.381 . . . . 28.0 113.637 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 90.2 m -101.66 130.58 48.04 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.645 -0.778 . . . . 32.210000000000001 109.966 179.834 -64.817 -87.23 -93.545 102.411 2.031 103.227 -88.072 -70.179 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 89.4 mmt-85 . . . . . 0 C--O 1.248 1.008 0 CA-C-N 115.198 -0.91 . . . . 22.300000000000001 110.035 -178.942 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 600' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ARG . . . . . 0.451 ' O ' ' HB2' ' A' ' 10' ' ' LEU . 37.0 ptt85 . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 120.847 0.356 . . . . 89.49 111.815 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 9' ' ' ARG . 29.8 tp 176.6 115.96 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.345 -0.389 . . . . 82.48 110.372 -179.951 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -156.67 -174.21 4.83 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.19 0.811 . . . . 78.85 113.19 -179.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 89.6 p -64.12 -163.49 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 114.19 -1.368 . . . . 71.41 111.586 -176.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.5 p -39.98 157.47 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 114.952 -1.022 . . . . 60.44 113.283 -175.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 53.2 t -56.85 129.29 40.78 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 112.796 -2.002 . . . . 48.3 108.272 178.075 -178.963 52.573 78.522 106.102 1.958 106.934 69.261 178.06 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . 0.458 ' NZ ' ' CB ' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -160.9 167.87 25.76 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.98 0.419 . . . . 46.5 111.344 179.487 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -88.67 135.67 33.39 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.735 -0.666 . . . . 39.7 111.248 179.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HIS . . . . . 0.458 ' HB2' ' CE1' ' A' ' 42' ' ' TYR . 55.1 m80 -118.21 148.74 44.38 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 115.375 -0.83 . . . . 47.35 110.588 -179.898 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -70.63 146.98 56.28 Favored 'Trans proline' 0 CA--C 1.518 -0.316 0 C-N-CA 120.683 0.922 . . . . 40.86 111.583 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 44.8 tp -165.4 109.21 0.85 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.795 -0.638 . . . . 36.91 111.121 179.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -95.65 137.42 34.74 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 104.879 -2.267 . . . . 34.62 104.879 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.1 t -117.37 117.95 56.95 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 C-N-CA 119.401 -0.92 . . . . 34.03 111.992 179.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASP . . . . . 0.48 ' HB3' ' OD2' ' A' ' 25' ' ' ASP . 9.4 t70 -93.73 115.91 28.36 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 107.615 -1.254 . . . . 35.74 107.615 179.357 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -57.42 -20.13 28.17 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 115.486 1.662 . . . . 32.24 115.486 -178.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . 0.502 ' HA ' ' OD1' ' A' ' 29' ' ' ASN . 66.6 m -79.09 -31.8 44.45 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.824 -0.171 . . . . 39.46 110.822 179.535 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASP . . . . . 0.48 ' OD2' ' HB3' ' A' ' 22' ' ' ASP . 73.0 m-20 -71.2 -33.52 70.01 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 120.935 -0.306 . . . . 45.72 111.159 179.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 14.1 m -97.38 10.02 6.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.505 -0.478 . . . . 40.0 110.802 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 62.09 45.74 95.46 Favored Glycine 0 N--CA 1.451 -0.304 0 N-CA-C 116.801 1.48 . . . . 37.26 116.801 178.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 14.7 m0 -116.58 -13.63 10.88 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 112.659 0.614 . . . . 36.44 112.659 179.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASN . . . . . 0.502 ' OD1' ' HA ' ' A' ' 24' ' ' SER . 16.3 p-10 -61.24 -11.66 10.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.978 0.418 . . . . 39.74 109.876 -179.671 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -69.25 -40.36 77.91 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 119.588 -0.845 . . . . 40.95 109.75 179.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 19.0 p-90 -105.42 -21.89 13.13 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.792 1.034 . . . . 32.83 113.792 -179.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 58.9 mt -95.4 111.72 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.443 0 C-N-CA 119.7 -0.8 . . . . 24.18 110.441 179.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.6 t -69.88 -49.07 59.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 CA-C-N 115.461 -0.791 . . . . 22.54 110.204 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -154.25 150.38 22.22 Favored Pre-proline 0 C--O 1.235 0.336 0 CA-C-O 120.928 0.395 . . . . 25.2 110.653 -179.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PRO . . . . . 0.469 ' HB2' ' HD2' ' A' ' 36' ' ' PRO . 15.8 Cg_endo -73.96 -175.92 16.23 Favored 'Cis proline' 0 N--CA 1.461 -0.395 0 N-CA-C 110.048 -0.789 . . . . 24.44 110.048 0.017 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PRO . . . . . 0.469 ' HD2' ' HB2' ' A' ' 35' ' ' PRO . 94.2 Cg_endo -81.34 -24.72 4.29 Favored 'Trans proline' 0 N--CA 1.464 -0.244 0 N-CA-C 108.623 -1.337 . . . . 25.17 108.623 179.488 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -171.13 -167.92 32.11 Favored Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 108.265 -1.934 . . . . 25.59 108.265 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' TYR . . . . . 0.436 ' CZ ' ' HB2' ' A' ' 40' ' ' ALA . 9.7 p90 -170.18 158.26 6.77 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 114.637 1.347 . . . . 24.61 114.637 179.032 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -82.9 95.98 8.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.017 -0.992 . . . . 33.86 109.336 179.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . 0.436 ' HB2' ' CZ ' ' A' ' 38' ' ' TYR . . . -88.9 -35.48 16.48 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 114.997 1.48 . . . . 26.83 114.997 -178.577 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 67.24 177.84 0.24 Allowed 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.099 -1.445 . . . . 26.69 107.099 -176.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' TYR . . . . . 0.458 ' CE1' ' HB2' ' A' ' 17' ' ' HIS . 19.2 p90 -164.62 166.24 20.33 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 108.705 -0.85 . . . . 38.63 108.705 178.17 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 69.2 m -113.14 145.35 41.1 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.541 0.686 . . . . 33.42 112.593 -178.95 -58.309 -73.426 -83.156 103.751 2.026 104.727 -76.126 -59.825 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -168.74 153.84 6.19 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.588 -0.893 . . . . 38.94 108.588 179.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 129.19 136.06 4.05 Favored Glycine 0 N--CA 1.449 -0.454 0 N-CA-C 109.429 -1.468 . . . . 41.91 109.429 -178.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -59.92 147.56 38.23 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.787 1.032 . . . . 50.75 113.787 -179.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 91.1 m -103.14 90.29 2.4 Favored Pre-proline 0 C--O 1.236 0.39 0 N-CA-C 105.994 -1.854 . . . . 51.06 105.994 177.621 -70.179 -88.072 -93.545 103.227 2.031 102.411 -87.23 -64.817 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -56.28 155.29 25.34 Favored 'Trans proline' 0 C--N 1.344 0.336 1 C-N-CA 125.614 4.209 . . . . 60.13 116.466 -179.425 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . 0.659 ' HA ' ' CG2' ' A' ' 65' ' ' THR . 5.2 t80 -71.94 -43.59 10.87 Favored Pre-proline 0 C--O 1.234 0.261 0 CA-C-N 115.588 -0.733 . . . . 70.5 112.62 179.943 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -62.54 6.67 0.18 Allowed 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 117.802 -0.999 . . . . 73.81 113.02 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . 0.455 ' H ' ' C ' ' A' ' 49' ' ' PHE . 68.8 mt 39.68 88.17 0.01 OUTLIER 'General case' 0 C--O 1.239 0.504 0 N-CA-C 115.828 1.788 . . . . 75.52 115.828 178.15 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -47.93 133.31 14.6 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 114.406 -1.27 . . . . 75.35 112.358 169.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -65.12 -66.13 0.58 Allowed 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.511 -0.768 . . . . 78.66 110.599 -178.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' HIS . . . . . 0.408 ' ND1' ' N ' ' A' ' 55' ' ' LEU . 32.0 p80 -38.61 -42.53 0.79 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.521 -0.763 . . . . 72.55 110.496 179.913 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . 0.456 HD21 ' SG ' ' A' ' 113' ' ' CYS . 31.8 tp -74.87 134.16 41.71 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.363 -0.977 . . . . 65.74 108.363 179.561 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -99.72 140.16 34.33 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 113.723 1.008 . . . . 55.72 113.723 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.5 m -135.56 141.3 45.16 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.316 -0.856 . . . . 45.58 109.974 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.0 p -74.07 167.52 21.38 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 104.631 -2.359 . . . . 33.78 104.631 177.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -57.86 -41.37 82.29 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 109.121 -0.696 . . . . 25.59 109.121 179.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.2 t-80 -59.79 -50.0 75.54 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.742 -0.663 . . . . 23.0 109.867 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . 0.415 ' HA ' ' O ' ' A' ' 327' ' ' HOH . . . -51.23 -43.1 61.4 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.099 0.476 . . . . 20.64 110.396 179.785 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 74.9 mt -63.64 -48.5 86.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.215 0.531 . . . . 22.37 110.532 -179.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 75.0 t -57.79 -46.22 87.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.812 -0.631 . . . . 23.51 109.858 179.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -68.13 -36.19 79.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.153 0.501 . . . . 30.77 112.301 -178.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . 0.659 ' CG2' ' HA ' ' A' ' 49' ' ' PHE . 40.7 m -60.78 -46.89 88.73 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.193 -1.04 . . . . 32.75 108.193 178.742 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 34.0 tp -62.26 -50.03 73.36 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.625 -0.716 . . . . 33.94 111.4 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 51.1 t -53.54 -48.37 58.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 108.929 -0.767 . . . . 35.19 108.929 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASN . . . . . 0.441 ' HA ' ' O ' ' A' ' 71' ' ' ASN . 26.2 t-20 -52.08 -37.59 54.42 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 114.97 -1.014 . . . . 39.91 113.134 -179.531 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 79.8 p -75.09 -8.92 57.9 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.834 0.679 . . . . 45.21 112.834 -179.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . 0.463 HG12 ' O ' ' A' ' 70' ' ' VAL . 93.4 t -119.29 -2.17 9.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.604 -0.888 . . . . 47.18 108.604 -179.21 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 68' ' ' ASN . 4.4 t-20 -167.77 118.53 0.83 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.238 -1.393 . . . . 51.86 107.238 179.482 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 71.0 m -89.87 -3.32 58.15 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 117.151 2.278 . . . . 47.12 117.151 -177.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 36.0 mmtm -71.35 -12.43 61.42 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 107.903 -1.147 . . . . 49.04 107.903 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ILE . . . . . 0.424 HG12 ' OD1' ' A' ' 71' ' ' ASN . 49.7 mm -105.7 127.39 28.56 Favored Pre-proline 0 C--O 1.238 0.493 0 N-CA-C 107.291 -1.374 . . . . 37.46 107.291 178.561 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 74' ' ' ILE . 62.2 Cg_exo -60.79 153.25 64.06 Favored 'Trans proline' 0 C--N 1.345 0.368 1 C-N-CA 126.529 4.819 . . . . 33.32 114.345 -179.591 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 65.4 mttt -76.42 171.7 14.15 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 106.781 -1.563 . . . . 38.3 106.781 177.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.34 138.22 47.16 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 105.912 -1.885 . . . . 33.04 105.912 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' CYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 113' ' ' CYS . 5.4 t -81.81 154.83 25.72 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 114.378 1.251 . . . . 30.79 114.378 -178.613 -158.461 0.0 0.0 0.0 0.0 0.0 0.0 -158.461 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 42.1 t -95.71 93.04 6.88 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.534 -0.757 . . . . 28.45 110.267 179.992 178.06 69.261 78.522 106.934 1.958 106.102 52.573 -178.963 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 13.1 m -115.91 170.85 5.22 Favored Pre-proline 0 N--CA 1.445 -0.72 0 CA-C-N 115.737 -0.665 . . . . 24.85 111.193 -179.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -72.35 135.17 24.08 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 121.537 1.491 . . . . 24.48 109.3 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 67.1 p -115.94 -13.91 11.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.963 0.411 . . . . 22.98 111.773 -179.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -138.76 117.78 12.53 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.177 -1.046 . . . . 20.56 108.177 179.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.5 mp -122.22 173.28 7.7 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.627 0.727 . . . . 18.84 112.874 -179.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 91.1 p -147.95 165.78 29.67 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 107.574 -1.269 . . . . 18.8 107.574 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ALA . . . . . 0.449 ' HB2' ' HA ' ' A' ' 104' ' ' GLN . . . -103.04 169.4 8.59 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 114.94 1.459 . . . . 16.89 114.94 -177.086 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 22.0 pt -144.37 154.71 15.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 106.621 -1.622 . . . . 17.69 106.621 176.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 38.4 m -89.14 148.2 23.79 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 121.323 0.582 . . . . 26.11 109.955 178.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 29.3 mtm -144.28 132.35 21.64 Favored 'General case' 0 CA--C 1.497 -1.087 0 N-CA-C 108.318 -0.993 . . . . 19.76 108.318 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 54.4 tp -100.29 120.42 39.9 Favored 'General case' 0 N--CA 1.439 -1.009 0 N-CA-C 101.628 -3.471 . . . . 19.3 101.628 178.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -141.56 -175.75 4.48 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 119.785 -0.766 . . . . 20.62 110.386 -179.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LEU . . . . . 0.462 ' HA ' ' O ' ' A' ' 97' ' ' LYS . 11.5 mt -124.2 115.65 21.43 Favored 'General case' 0 C--N 1.332 -0.155 0 O-C-N 123.909 0.756 . . . . 30.85 109.015 -179.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.8 p30 -66.46 -175.53 0.37 Allowed 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 119.131 -1.028 . . . . 38.8 110.202 -179.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . 0.648 ' CD ' ' H ' ' A' ' 94' ' ' GLU . 1.2 pm0 -59.29 -15.28 14.91 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 114.791 1.404 . . . . 50.58 114.791 -179.201 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 96' ' ' GLU . 76.9 m-20 -104.26 12.23 33.93 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 113.106 0.78 . . . . 43.07 113.106 -179.909 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 95' ' ' ASN . 70.8 mm-40 67.27 27.86 8.19 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.158 0.799 . . . . 43.48 113.158 179.638 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . 0.462 ' O ' ' HA ' ' A' ' 92' ' ' LEU . 91.5 mttt -90.38 141.99 28.18 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 106.162 -1.792 . . . . 37.05 106.162 176.929 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 45.8 t -85.99 117.66 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 N-CA-C 108.478 -0.934 . . . . 27.79 108.478 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 4.8 t -116.77 139.32 44.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.848 -0.615 . . . . 25.28 112.105 -178.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 62.2 tp -114.22 101.69 9.43 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 102.83 -3.026 . . . . 21.89 102.83 176.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -117.98 148.76 41.9 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.908 0.385 . . . . 35.37 111.847 -178.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -99.63 101.6 12.84 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 106.414 -1.699 . . . . 37.9 106.414 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -82.52 122.04 27.55 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 114.442 1.275 . . . . 21.34 114.442 -178.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLN . . . . . 0.449 ' HA ' ' HB2' ' A' ' 86' ' ' ALA . 50.0 mm-40 -82.12 159.88 23.26 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 113.074 0.768 . . . . 33.03 113.074 -179.788 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 57.36 38.47 28.43 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.482 0.919 . . . . 25.15 113.482 177.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 80.0 mmm -97.82 -35.92 10.36 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.957 0.725 . . . . 20.21 112.957 -179.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 53.8 t -111.75 131.36 63.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 114.52 1.304 . . . . 18.71 114.52 -178.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 75.9 t -80.68 110.0 15.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.023 -0.535 . . . . 24.87 111.675 178.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -89.52 -47.6 7.87 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.011 -0.737 . . . . 33.43 109.011 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -133.28 153.65 20.87 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.237 -0.982 . . . . 26.87 114.717 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 84.2 m -116.78 157.25 25.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.556 0.693 . . . . 29.13 112.332 179.479 -59.825 -76.126 -83.156 104.727 2.026 103.751 -73.426 -58.309 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -162.38 177.0 38.7 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 119.4 -1.381 . . . . 28.0 113.637 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' CYS . . . . . 0.456 ' SG ' HD21 ' A' ' 55' ' ' LEU . 90.2 m -101.66 130.58 48.04 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.645 -0.778 . . . . 32.21 109.966 179.834 -64.817 -87.23 -93.545 102.411 2.031 103.227 -88.072 -70.179 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 89.4 mmt-85 . . . . . 0 C--O 1.248 1.008 0 CA-C-N 115.198 -0.91 . . . . 22.3 110.035 -178.942 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 600' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . 0.415 ' O ' ' HA ' ' A' ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.451 ' O ' ' HB2' ' A' ' 10' ' ' LEU . 37.0 ptt85 . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 120.847 0.356 . . . . 89.49 111.815 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 9' ' ' ARG . 29.8 tp 176.6 115.96 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.345 -0.389 . . . . 82.48 110.372 -179.951 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -156.67 -174.21 4.83 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.19 0.811 . . . . 78.85 113.19 -179.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 89.6 p -64.12 -163.49 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 114.19 -1.368 . . . . 71.41 111.586 -176.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 83.5 p -39.98 157.47 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 114.952 -1.022 . . . . 60.44 113.283 -175.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 53.2 t -56.85 129.29 40.78 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 112.796 -2.002 . . . . 48.3 108.272 178.075 -178.963 52.573 78.522 106.102 1.958 106.934 69.261 178.06 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.458 ' NZ ' ' CB ' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -160.9 167.87 25.76 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.98 0.419 . . . . 46.5 111.344 179.487 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -88.67 135.67 33.39 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.735 -0.666 . . . . 39.7 111.248 179.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.458 ' HB2' ' CE1' ' A' ' 42' ' ' TYR . 55.1 m80 -118.21 148.74 44.38 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 115.375 -0.83 . . . . 47.35 110.588 -179.898 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -70.63 146.98 56.28 Favored 'Trans proline' 0 CA--C 1.518 -0.316 0 C-N-CA 120.683 0.922 . . . . 40.86 111.583 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 44.8 tp -165.4 109.21 0.85 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.795 -0.638 . . . . 36.91 111.121 179.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -95.65 137.42 34.74 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 104.879 -2.267 . . . . 34.62 104.879 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 40.1 t -117.37 117.95 56.95 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 C-N-CA 119.401 -0.92 . . . . 34.03 111.992 179.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.48 ' HB3' ' OD2' ' A' ' 25' ' ' ASP . 9.4 t70 -93.73 115.91 28.36 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 107.615 -1.254 . . . . 35.74 107.615 179.357 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -57.42 -20.13 28.17 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 115.486 1.662 . . . . 32.24 115.486 -178.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . 0.502 ' HA ' ' OD1' ' A' ' 29' ' ' ASN . 66.6 m -79.09 -31.8 44.45 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.824 -0.171 . . . . 39.46 110.822 179.535 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.48 ' OD2' ' HB3' ' A' ' 22' ' ' ASP . 73.0 m-20 -71.2 -33.52 70.01 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 120.935 -0.306 . . . . 45.72 111.159 179.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 14.1 m -97.38 10.02 6.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.505 -0.478 . . . . 40.0 110.802 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 62.09 45.74 95.46 Favored Glycine 0 N--CA 1.451 -0.304 0 N-CA-C 116.801 1.48 . . . . 37.26 116.801 178.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 14.7 m0 -116.58 -13.63 10.88 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 112.659 0.614 . . . . 36.44 112.659 179.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.502 ' OD1' ' HA ' ' A' ' 24' ' ' SER . 16.3 p-10 -61.24 -11.66 10.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.978 0.418 . . . . 39.74 109.876 -179.671 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.0 p-10 -69.25 -40.36 77.91 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 119.588 -0.845 . . . . 40.95 109.75 179.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 19.0 p-90 -105.42 -21.89 13.13 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.792 1.034 . . . . 32.83 113.792 -179.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 58.9 mt -95.4 111.72 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.443 0 C-N-CA 119.7 -0.8 . . . . 24.18 110.441 179.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.6 t -69.88 -49.07 59.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 CA-C-N 115.461 -0.791 . . . . 22.54 110.204 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -154.25 150.38 22.22 Favored Pre-proline 0 C--O 1.235 0.336 0 CA-C-O 120.928 0.395 . . . . 25.2 110.653 -179.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.469 ' HB2' ' HD2' ' A' ' 36' ' ' PRO . 15.8 Cg_endo -73.96 -175.92 16.23 Favored 'Cis proline' 0 N--CA 1.461 -0.395 0 N-CA-C 110.048 -0.789 . . . . 24.44 110.048 0.017 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.469 ' HD2' ' HB2' ' A' ' 35' ' ' PRO . 94.2 Cg_endo -81.34 -24.72 4.29 Favored 'Trans proline' 0 N--CA 1.464 -0.244 0 N-CA-C 108.623 -1.337 . . . . 25.17 108.623 179.488 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -171.13 -167.92 32.11 Favored Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 108.265 -1.934 . . . . 25.59 108.265 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.436 ' CZ ' ' HB2' ' A' ' 40' ' ' ALA . 9.7 p90 -170.18 158.26 6.77 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 114.637 1.347 . . . . 24.61 114.637 179.032 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -82.9 95.98 8.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.017 -0.992 . . . . 33.86 109.336 179.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.436 ' HB2' ' CZ ' ' A' ' 38' ' ' TYR . . . -88.9 -35.48 16.48 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 114.997 1.48 . . . . 26.83 114.997 -178.577 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 67.24 177.84 0.24 Allowed 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.099 -1.445 . . . . 26.69 107.099 -176.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.458 ' CE1' ' HB2' ' A' ' 17' ' ' HIS . 19.2 p90 -164.62 166.24 20.33 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 108.705 -0.85 . . . . 38.63 108.705 178.17 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 69.2 m -113.14 145.35 41.1 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.541 0.686 . . . . 33.42 112.593 -178.95 -58.309 -73.426 -83.156 103.751 2.026 104.727 -76.126 -59.825 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -168.74 153.84 6.19 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.588 -0.893 . . . . 38.94 108.588 179.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 129.19 136.06 4.05 Favored Glycine 0 N--CA 1.449 -0.454 0 N-CA-C 109.429 -1.468 . . . . 41.91 109.429 -178.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -59.92 147.56 38.23 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.787 1.032 . . . . 50.75 113.787 -179.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 91.1 m -103.14 90.29 2.4 Favored Pre-proline 0 C--O 1.236 0.39 0 N-CA-C 105.994 -1.854 . . . . 51.06 105.994 177.621 -70.179 -88.072 -93.545 103.227 2.031 102.411 -87.23 -64.817 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -56.28 155.29 25.34 Favored 'Trans proline' 0 C--N 1.344 0.336 1 C-N-CA 125.614 4.209 . . . . 60.13 116.466 -179.425 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.659 ' HA ' ' CG2' ' A' ' 65' ' ' THR . 5.2 t80 -71.94 -43.59 10.87 Favored Pre-proline 0 C--O 1.234 0.261 0 CA-C-N 115.588 -0.733 . . . . 70.5 112.62 179.943 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -62.54 6.67 0.18 Allowed 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 117.802 -0.999 . . . . 73.81 113.02 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.455 ' H ' ' C ' ' A' ' 49' ' ' PHE . 68.8 mt 39.68 88.17 0.01 OUTLIER 'General case' 0 C--O 1.239 0.504 0 N-CA-C 115.828 1.788 . . . . 75.52 115.828 178.15 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -47.93 133.31 14.6 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 114.406 -1.27 . . . . 75.35 112.358 169.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -65.12 -66.13 0.58 Allowed 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.511 -0.768 . . . . 78.66 110.599 -178.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.408 ' ND1' ' N ' ' A' ' 55' ' ' LEU . 32.0 p80 -38.61 -42.53 0.79 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.521 -0.763 . . . . 72.55 110.496 179.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.456 HD21 ' SG ' ' A' ' 113' ' ' CYS . 31.8 tp -74.87 134.16 41.71 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.363 -0.977 . . . . 65.74 108.363 179.561 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -99.72 140.16 34.33 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 113.723 1.008 . . . . 55.72 113.723 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.5 m -135.56 141.3 45.16 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.316 -0.856 . . . . 45.58 109.974 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 6.0 p -74.07 167.52 21.38 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 104.631 -2.359 . . . . 33.78 104.631 177.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -57.86 -41.37 82.29 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 109.121 -0.696 . . . . 25.59 109.121 179.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.516 ' HD2' ' O ' ' A' ' 327' ' ' HOH . 45.9 t60 -59.79 -50.0 75.54 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.742 -0.663 . . . . 23.0 109.867 179.844 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.415 ' HA ' ' O ' ' A' ' 327' ' ' HOH . . . -51.23 -43.1 61.4 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.099 0.476 . . . . 20.64 110.396 179.785 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 74.9 mt -63.64 -48.5 86.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.215 0.531 . . . . 22.37 110.532 -179.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 75.0 t -57.79 -46.22 87.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.812 -0.631 . . . . 23.51 109.858 179.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -68.13 -36.19 79.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.153 0.501 . . . . 30.77 112.301 -178.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . 0.659 ' CG2' ' HA ' ' A' ' 49' ' ' PHE . 40.7 m -60.78 -46.89 88.73 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.193 -1.04 . . . . 32.75 108.193 178.742 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 34.0 tp -62.26 -50.03 73.36 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.625 -0.716 . . . . 33.94 111.4 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 51.1 t -53.54 -48.37 58.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 108.929 -0.767 . . . . 35.19 108.929 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.441 ' HA ' ' O ' ' A' ' 71' ' ' ASN . 26.2 t-20 -52.08 -37.59 54.42 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 114.97 -1.014 . . . . 39.91 113.134 -179.531 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 79.8 p -75.09 -8.92 57.9 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.834 0.679 . . . . 45.21 112.834 -179.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.463 HG12 ' O ' ' A' ' 70' ' ' VAL . 93.4 t -119.29 -2.17 9.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.604 -0.888 . . . . 47.18 108.604 -179.21 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.578 ' ND2' HG12 ' A' ' 74' ' ' ILE . 7.0 t30 -167.77 118.53 0.83 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.238 -1.393 . . . . 51.86 107.238 179.482 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 71.0 m -89.87 -3.32 58.15 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 117.151 2.278 . . . . 47.12 117.151 -177.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 36.0 mmtm -71.35 -12.43 61.42 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 107.903 -1.147 . . . . 49.04 107.903 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.578 HG12 ' ND2' ' A' ' 71' ' ' ASN . 49.7 mm -105.7 127.39 28.56 Favored Pre-proline 0 C--O 1.238 0.493 0 N-CA-C 107.291 -1.374 . . . . 37.46 107.291 178.561 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 74' ' ' ILE . 62.2 Cg_exo -60.79 153.25 64.06 Favored 'Trans proline' 0 C--N 1.345 0.368 1 C-N-CA 126.529 4.819 . . . . 33.32 114.345 -179.591 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 65.4 mttt -76.42 171.7 14.15 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 106.781 -1.563 . . . . 38.3 106.781 177.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -72.34 138.22 47.16 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 105.912 -1.885 . . . . 33.04 105.912 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' CYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 113' ' ' CYS . 5.4 t -81.81 154.83 25.72 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 114.378 1.251 . . . . 30.79 114.378 -178.613 -158.461 0.0 0.0 0.0 0.0 0.0 0.0 -158.461 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 42.1 t -95.71 93.04 6.88 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.534 -0.757 . . . . 28.45 110.267 179.992 178.06 69.261 78.522 106.934 1.958 106.102 52.573 -178.963 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 13.1 m -115.91 170.85 5.22 Favored Pre-proline 0 N--CA 1.445 -0.72 0 CA-C-N 115.737 -0.665 . . . . 24.85 111.193 -179.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -72.35 135.17 24.08 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 121.537 1.491 . . . . 24.48 109.3 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 67.1 p -115.94 -13.91 11.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.963 0.411 . . . . 22.98 111.773 -179.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -138.76 117.78 12.53 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.177 -1.046 . . . . 20.56 108.177 179.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.5 mp -122.22 173.28 7.7 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.627 0.727 . . . . 18.84 112.874 -179.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 91.1 p -147.95 165.78 29.67 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 107.574 -1.269 . . . . 18.8 107.574 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.449 ' HB2' ' HA ' ' A' ' 104' ' ' GLN . . . -103.04 169.4 8.59 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 114.94 1.459 . . . . 16.89 114.94 -177.086 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 22.0 pt -144.37 154.71 15.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 106.621 -1.622 . . . . 17.69 106.621 176.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 38.4 m -89.14 148.2 23.79 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 121.323 0.582 . . . . 26.11 109.955 178.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 29.3 mtm -144.28 132.35 21.64 Favored 'General case' 0 CA--C 1.497 -1.087 0 N-CA-C 108.318 -0.993 . . . . 19.76 108.318 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 54.4 tp -100.29 120.42 39.9 Favored 'General case' 0 N--CA 1.439 -1.009 0 N-CA-C 101.628 -3.471 . . . . 19.3 101.628 178.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -141.56 -175.75 4.48 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 119.785 -0.766 . . . . 20.62 110.386 -179.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.462 ' HA ' ' O ' ' A' ' 97' ' ' LYS . 11.5 mt -124.2 115.65 21.43 Favored 'General case' 0 C--N 1.332 -0.155 0 O-C-N 123.909 0.756 . . . . 30.85 109.015 -179.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 16.8 p30 -66.46 -175.53 0.37 Allowed 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 119.131 -1.028 . . . . 38.8 110.202 -179.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.648 ' CD ' ' H ' ' A' ' 94' ' ' GLU . 1.2 pm0 -59.29 -15.28 14.91 Favored 'General case' 0 C--O 1.24 0.597 0 N-CA-C 114.791 1.404 . . . . 50.58 114.791 -179.201 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 96' ' ' GLU . 76.9 m-20 -104.26 12.23 33.93 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 113.106 0.78 . . . . 43.07 113.106 -179.909 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 95' ' ' ASN . 70.8 mm-40 67.27 27.86 8.19 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.158 0.799 . . . . 43.48 113.158 179.638 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.462 ' O ' ' HA ' ' A' ' 92' ' ' LEU . 91.5 mttt -90.38 141.99 28.18 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 106.162 -1.792 . . . . 37.05 106.162 176.929 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 45.8 t -85.99 117.66 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 N-CA-C 108.478 -0.934 . . . . 27.79 108.478 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 4.8 t -116.77 139.32 44.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.848 -0.615 . . . . 25.28 112.105 -178.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 62.2 tp -114.22 101.69 9.43 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 102.83 -3.026 . . . . 21.89 102.83 176.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -117.98 148.76 41.9 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.908 0.385 . . . . 35.37 111.847 -178.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -99.63 101.6 12.84 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 106.414 -1.699 . . . . 37.9 106.414 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -82.52 122.04 27.55 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 114.442 1.275 . . . . 21.34 114.442 -178.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.449 ' HA ' ' HB2' ' A' ' 86' ' ' ALA . 4.2 mm100 -82.12 159.88 23.26 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 113.074 0.768 . . . . 33.03 113.074 -179.788 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 57.36 38.47 28.43 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.482 0.919 . . . . 25.15 113.482 177.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 80.0 mmm -97.82 -35.92 10.36 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.957 0.725 . . . . 20.21 112.957 -179.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 53.8 t -111.75 131.36 63.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 114.52 1.304 . . . . 18.71 114.52 -178.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 75.9 t -80.68 110.0 15.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.023 -0.535 . . . . 24.87 111.675 178.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -89.52 -47.6 7.87 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.011 -0.737 . . . . 33.43 109.011 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -133.28 153.65 20.87 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.237 -0.982 . . . . 26.87 114.717 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 84.2 m -116.78 157.25 25.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.556 0.693 . . . . 29.13 112.332 179.479 -59.825 -76.126 -83.156 104.727 2.026 103.751 -73.426 -58.309 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -162.38 177.0 38.7 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 119.4 -1.381 . . . . 28.0 113.637 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' CYS . . . . . 0.456 ' SG ' HD21 ' A' ' 55' ' ' LEU . 90.2 m -101.66 130.58 48.04 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.645 -0.778 . . . . 32.21 109.966 179.834 -64.817 -87.23 -93.545 102.411 2.031 103.227 -88.072 -70.179 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 89.4 mmt-85 . . . . . 0 C--O 1.248 1.008 0 CA-C-N 115.198 -0.91 . . . . 22.3 110.035 -178.942 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 600' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . 0.516 ' O ' ' HD2' ' A' ' 60' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_